ethyl (E)-3-[1-[(4-methylphenyl)methyl]indol-5-yl]but-2-enoate

Systemtic Name: ethyl (E)-3-[1-[(4-methylphenyl)methyl]indol-5-yl]but-2-enoate Openeye Name: ethyl (E)-3-[1-(p-tolylmethyl)indol-5-yl]but-2-enoate CAS Name: (E)-3-[1-[(4-methylphenyl)methyl]-5-indolyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[1-[(4-methylphenyl)methyl]indol-5-yl]but-2-enoate Traditional Name: (E)-3-[1-(4-methylbenzyl)indol-5-yl]but-2-enoic acid ethyl ester Formula: C22H23NO2 MolecularWeight: 333.42352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C1=CC2=C(C=C1)N(C=C2)CC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)/C=C(\C)/C1=CC2=C(C=C1)N(C=C2)CC3=CC=C(C=C3)C

InChI

InChI=1S/C22H23NO2/c1-4-25-22(24)13-17(3)19-9-10-21-20(14-19)11-12-23(21)15-18-7-5-16(2)6-8-18/h5-14H,4,15H2,1-3H3/b17-13+